Cas no 1125409-85-9 (ethyl 5-bromo-2-chloro-thiazole-4-carboxylate)

Ethyl 5-bromo-2-chloro-thiazole-4-carboxylate is a halogenated thiazole derivative commonly employed as a versatile intermediate in organic synthesis and pharmaceutical research. Its key structural features—a bromo and chloro substituent on the thiazole ring, along with an ester functional group—make it a valuable precursor for further functionalization, particularly in the synthesis of heterocyclic compounds and bioactive molecules. The compound exhibits high reactivity in cross-coupling reactions, enabling efficient derivatization for applications in medicinal chemistry and agrochemical development. Its stability under standard storage conditions and well-characterized reactivity profile contribute to its utility in laboratory and industrial settings.
ethyl 5-bromo-2-chloro-thiazole-4-carboxylate structure
1125409-85-9 structure
Product Name:ethyl 5-bromo-2-chloro-thiazole-4-carboxylate
CAS No:1125409-85-9
MF:C6H5BrClNO2S
MW:270.531398534775
MDL:MFCD16615260
CID:1088876
PubChem ID:38996182
Update Time:2025-06-08

ethyl 5-bromo-2-chloro-thiazole-4-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 5-bromo-2-chlorothiazole-4-carboxylate
    • Ethyl 5-bromo-2-chloro-1,3-thiazole-4-carboxylate
    • ethyl 5-bromo-2-chloro-thiazole-4-carboxylate
    • ZB1766
    • Ethyl5-bromo-2-chlorothiazole-4-carboxylate
    • 1125409-85-9
    • DTXSID60653410
    • MFCD16615260
    • SY045945
    • AKOS015958327
    • CS-0076026
    • AVB40985
    • A894572
    • F2158-0659
    • EN300-236570
    • CS-15945
    • MDL: MFCD16615260
    • Inchi: 1S/C6H5BrClNO2S/c1-2-11-5(10)3-4(7)12-6(8)9-3/h2H2,1H3
    • InChI Key: IAUOQHXDFFIRLP-UHFFFAOYSA-N
    • SMILES: BrC1=C(C(=O)OCC)N=C(S1)Cl

Computed Properties

  • Exact Mass: 268.89129g/mol
  • Monoisotopic Mass: 268.89129g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 183
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.5
  • Topological Polar Surface Area: 67.4?2

Experimental Properties

  • Density: 1.7±0.1 g/cm3
  • Boiling Point: 333.8±45.0 °C at 760 mmHg
  • Flash Point: 155.7±28.7 °C
  • Vapor Pressure: 0.0±0.7 mmHg at 25°C

ethyl 5-bromo-2-chloro-thiazole-4-carboxylate Security Information

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI XIAN DING Biotechnology Co., Ltd.
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Chemenu
CM130638-1g
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Chemenu
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Ethyl 5-Bromo-2-chlorothiazole-4-carboxylate
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Chemenu
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